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canSAR1095154
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NAMES
    SMILES
    O[C@@H]1COC[C@H]1Nc1nc(Nc2cc(Cl)cc(Cl)c2)ncc1-c1cccnc1
    InChI
    InChI=1S/C19H17Cl2N5O2/c20-12-4-13(21)6-14(5-12)24-19-23-8-15(11-2-1-3-22-7-11)18(26-19)25-16-9-28-10-17(16)27/h1-8,16-17,27H,9-10H2,(H2,23,24,25,26)/t16-,17-/m1/s1
    MOLECULAR FORMULA
    C19H17Cl2N5O2
    CROSS REFERENCES
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    canSAR1095154

    Compound Synopsis

    OVERVIEW
    PROPERTIES
    Molecular weight 417.08
    AlogP 3.76
    HBond donors 3
    HBond acceptors 7
    Atoms 45
    Contains toxicophore No
    Contains PAINS No
    Commercially available Unknown
    Property color indications are based on Lipinski's Ro5.
    PROTEIN TARGETS
    No information about proteins targeted by canSAR1095154.